Glycoside
GD084672
Name:
NoneFormula:
C15H21O6N2BrSmiles:
Cc1c(Br)ccnc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1c(Br)ccnc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 405.25 | Num_heavy_atoms: | 24 |
| TPSA: | 121.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD37845
Formula: C9H11O2N2Br
Smiles:
Cc1c(Br)ccnc1C(=O)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 259.1 | Num_heavy_atoms: | 14 |
| TPSA: | 62.22 | NumAromaticRings: | 1 |
